2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide

C9H11Cl2NO2S — CID 78823145

IUPAC2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide
SMILESCCN(CCO)C(=O)c1cc(Cl)sc1Cl
InChIInChI=1S/C9H11Cl2NO2S/c1-2-12(3-4-13)9(14)6-5-7(10)15-8(6)11/h5,13H,2-4H2,1H3
InChIKeyHDGOICWLFZWCTE-UHFFFAOYSA-N
MW268.17 g/mol
LogP2.51
Rot. Bonds4

About 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide

2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide (PubChem CID 78823145) has the molecular formula C9H11Cl2NO2S and a molecular weight of 268.17 g/mol. Its IUPAC name is 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide
PubChem CID78823145
Molecular FormulaC9H11Cl2NO2S
Molecular Weight268.17 g/mol
Exact Mass266.99
IUPAC Name2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide
SMILESCCN(CCO)C(=O)c1cc(Cl)sc1Cl
InChIInChI=1S/C9H11Cl2NO2S/c1-2-12(3-4-13)9(14)6-5-7(10)15-8(6)11/h5,13H,2-4H2,1H3
InChIKeyHDGOICWLFZWCTE-UHFFFAOYSA-N
XLogP2.51
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.17
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide?
The IUPAC name of 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide (CID 78823145) is 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide.
What is the SMILES notation for 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide?
The canonical SMILES for 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide is CCN(CCO)C(=O)c1cc(Cl)sc1Cl.
What is the InChIKey of 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide?
The InChIKey is HDGOICWLFZWCTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2NO2S/c1-2-12(3-4-13)9(14)6-5-7(10)15-8(6)11/h5,13H,2-4H2,1H3.
What are the key properties of 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide?
2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide has a molecular weight of 268.17 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-ethyl-N-(2-hydroxyethyl)thiophene-3-carboxamide is sourced from PubChem (CID 78823145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).